methyl {3-[(3,4-dimethoxyphenyl)methyl]-6,10-dimethyl-8-oxo-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-7-yl}acetate
Chemical Structure Depiction of
methyl {3-[(3,4-dimethoxyphenyl)methyl]-6,10-dimethyl-8-oxo-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-7-yl}acetate
methyl {3-[(3,4-dimethoxyphenyl)methyl]-6,10-dimethyl-8-oxo-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-7-yl}acetate
Compound characteristics
| Compound ID: | D144-0600 |
| Compound Name: | methyl {3-[(3,4-dimethoxyphenyl)methyl]-6,10-dimethyl-8-oxo-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-7-yl}acetate |
| Molecular Weight: | 453.49 |
| Molecular Formula: | C25 H27 N O7 |
| Smiles: | CC1=C(CC(=O)OC)C(=O)Oc2c1cc1CN(Cc3ccc(c(c3)OC)OC)COc1c2C |
| Stereo: | ACHIRAL |
| logP: | 3.5192 |
| logD: | 1.5478 |
| logSw: | -3.6761 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 68.953 |
| InChI Key: | PQBDVGCZVUWFMR-UHFFFAOYSA-N |